ID: 101998
SMILES:c1(Cl)c(C)cc(O)c(Cc2cc(C3CCC(C)(C)OC3(C)C)cc3c2C=CC(C)(C)O3)[n+]1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 471.061
CB1 binding score: -14.883
InChIKey:ZNPRHWMADVFNRN-UHFFFAOYSA-O
ID: 101999
SMILES:C(c1cc2c(c(OC)c1OC)CC(O)C(C)(C)O2)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -14.969
InChIKey:DRYSRIOSUSMEQX-UHFFFAOYSA-N
ID: 102000
SMILES:C1CC(C)=CC(c2cc(CCCC)ccc2O)C1C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.578
CB1 binding score: -15.785
InChIKey:YQEZHBPMFZMIHP-UHFFFAOYSA-N
ID: 102001
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 102002
SMILES:C12C(C)(C)Oc3cc(C)c(Br)cc3C1C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -18.671
InChIKey:RPVWNWGEPFZWQS-UHFFFAOYSA-N
ID: 102003
SMILES:c12c(c(O)cc(C)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 102004
SMILES:C1(C)(C)C2(C)C(O)C1c1c(O)cc(CCC)cc1OC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -13.182
InChIKey:YJWKLBMQPKXPPM-UHFFFAOYSA-N
ID: 102005
SMILES:C(OC)Cc1cc(O)c(C2OC(C)(C)C(CCC(O)C)C(C)C2)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -15.044
InChIKey:ZMSNGGFALPRUCO-UHFFFAOYSA-N
ID: 102006
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 102007
SMILES:CC(c1cc(OC)c2c(c1)OC(C)(C)C1(O)C2CC(C)C1=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.358
InChIKey:FDQUEKAAHGEEIO-UHFFFAOYSA-N
ID: 102008
SMILES:C1C(C)(C)C(c2c(O)c(C(=O)O)c(CCCCC)cc2O)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.605
InChIKey:XCJCSZJWMOMRQF-UHFFFAOYSA-N
ID: 102009
SMILES:C(C1CC2(C)Oc3cc(C)c(OC(=O)C)cc3CC2=C(C)C1)(CCC=C(C)C)(C)SC#N
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 453.648
CB1 binding score: -17.791
InChIKey:UYNZGGABSHDAQS-UHFFFAOYSA-N
ID: 102010
SMILES:c1(O)ccc(O)c2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.145
InChIKey:YJSPCCRFFZMYHY-UHFFFAOYSA-N
ID: 102011
SMILES:c1(N)c(CCCO)cc2c(c1)OC(C)(C)C(CC=C(C)C)C(C)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 347.499
CB1 binding score: -15.055
InChIKey:XILPFUDULMOLLH-UHFFFAOYSA-N
ID: 102012
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1C(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.825
InChIKey:ZOQOWBOVOPMLPU-UHFFFAOYSA-N
ID: 102013
SMILES:c1(O)c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 102014
SMILES:C1(C(C)=C)C(c2ccc(CCCCC)cc2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 102015
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2OC(CCC(=O)OC)=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.603
InChIKey:UTDOEZMLAOFGRN-UHFFFAOYSA-N
ID: 102016
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCC)cc2O)C=C(C)CCC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -17.447
InChIKey:AGVFDAFZZGTHDN-UHFFFAOYSA-N
ID: 102017
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 102018
SMILES:CCCCCc1cc2c(c(O)c1)C1C3C(C)(CCCC3=C)CCC1=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.573
CB1 binding score: -16.393
InChIKey:FQFYBFNOLVCXLE-UHFFFAOYSA-N